321386 <common-name>2-[[4-[benzyl(ethyl)amino]-2-methylphenyl]methylidene]propanedinitrile</common-name> <description>2-[[4-[benzyl(ethyl)amino]-2-methylphenyl]methylidene]propanedinitrile is a chemical compound with the formula C20H19N3. It has an average molecular weight of 301.40 g/mol.</description> <cas>97461-15-9</cas> <pubchem-id>44148544</pubchem-id> <chemical-formula>C20H19N3</chemical-formula> <weight>301.4</weight> <appearance nil="true"/> <melting-point nil="true"/> <boiling-point nil="true"/> <density nil="true"/> <solubility nil="true"/> <specific-gravity nil="true"/> <flash-point nil="true"/> <vapour-pressure nil="true"/> <route-of-exposure nil="true"/> <target nil="true"/> <mechanism-of-toxicity nil="true"/> <metabolism nil="true"/> <toxicity nil="true"/> <lethaldose nil="true"/> <carcinogenicity nil="true"/> <use-source nil="true"/> <min-risk-level nil="true"/> <health-effects nil="true"/> <symptoms nil="true"/> <treatment nil="true"/> <created-at type="dateTime">2026-08-29T20:50:13Z</created-at> <updated-at type="dateTime">2026-08-29T20:50:13Z</updated-at> <interacting-proteins nil="true"/> <wikipedia nil="true"/> <uniprot-id nil="true"/> <kegg-compound-id nil="true"/> <omim-id nil="true"/> <chebi-id nil="true"/> <biocyc-id nil="true"/> <ctd-id nil="true"/> <stitch-id nil="true"/> <drugbank-id nil="true"/> <pdb-id nil="true"/> <actor-id nil="true"/> <organism nil="true"/> <export type="boolean">true</export> <metabolizing-proteins nil="true"/> <transporting-proteins nil="true"/> <moldb-smiles>CCN(CC1=CC=CC=C1)C2=CC(=C(C=C2)C=C(C#N)C#N)C</moldb-smiles> <moldb-formula>C20H19N3</moldb-formula> <moldb-inchi>InChI=1S/C20H19N3/c1-3-23(15-17-7-5-4-6-8-17)20-10-9-19(16(2)11-20)12-18(13-21)14-22/h4-12H,3,15H2,1-2H3</moldb-inchi> <moldb-inchikey>CDOBZIXOHFSLGP-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">301.1578976</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>4.3</logp> <hmdb-id nil="true"/> <chembl-id nil="true"/> <chemspider-id nil="true"/> <structure-image-file-name nil="true"/> <structure-image-content-type nil="true"/> <structure-image-file-size type="integer" nil="true"/> <structure-image-updated-at type="dateTime" nil="true"/> <biodb-id nil="true"/> <synthesis-reference nil="true"/> <structure-image-caption nil="true"/> <chemdb-id>CHEM317279</chemdb-id> <dsstox-id nil="true"/> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id nil="true"/> <iupac>2-[[4-[benzyl(ethyl)amino]-2-methylphenyl]methylidene]propanedinitrile</iupac> <moldb-polar-surface-area nil="true"/> <moldb-refractivity nil="true"/> <moldb-polarizability nil="true"/> <moldb-rotatable-bond-count nil="true"/> <moldb-acceptor-count nil="true"/> <moldb-donor-count nil="true"/> <moldb-pka-strongest-acidic nil="true"/> <moldb-pka-strongest-basic nil="true"/> <moldb-physiological-charge nil="true"/> <moldb-number-of-rings nil="true"/> <moldb-alogps-logp nil="true"/> <moldb-alogps-logs nil="true"/> <moldb-alogps-solubility nil="true"/> <kingdom>Organic compounds</kingdom> <superklass>Benzenoids</superklass> <klass>Benzene and substituted derivatives</klass> <subklass>Phenylmethylamines</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0272107</sync-id> <structure-inchikey>CDOBZIXOHFSLGP-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>8000000000000000000000000800000000000000000000000080020000000000000000000000040000000001000000000800000000100000000000000000000000000000000000000000201002000000000000000000000002001100000000000000001040000000000008000000c000002000000000000000004020040080c000000000001000000000000100000000800000000000000000000000000000000000088900000000000000000000000000004000000000000000000000000000000000000000000001000000002000002220000000000000000000000000000040000000000000800000000000000000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ������������������������€���`�������`�������(�������`������@(������@h�������@h�������@h�������@h�������@h�������@(������@h�������@(������@(������@h�������@h��������h��������(�������(�������(�������(�������(�������`��������������������h���h���h���h�� h�� �h���h�� h� �h���h� � ��(��� ��(��� ��(���� �h�� h�B��������� ���� �� ����������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:26:14Z</structure-indexed-at> </compound>